CID 82718497

3-(aminomethyl)-2-methyloxolan-3-ol

Structural Information

Molecular Formula
C6H13NO2
SMILES
CC1C(CCO1)(CN)O
InChI
InChI=1S/C6H13NO2/c1-5-6(8,4-7)2-3-9-5/h5,8H,2-4,7H2,1H3
InChIKey
JPSVZTKDIWJGDJ-UHFFFAOYSA-N
Compound name
3-(aminomethyl)-2-methyloxolan-3-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

131.09464 Da
Monoisotopic Mass

-1.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 132.10192 126.1
[M+Na]+ 154.08386 134.6
[M+NH4]+ 149.12846 135.5
[M+K]+ 170.05780 130.7
[M-H]- 130.08736 128.1
[M+Na-2H]- 152.06931 130.5
[M]+ 131.09409 127.7
[M]- 131.09519 127.7
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.